1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide

C8H11N3O3S — CID 114612010

IUPAC1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide
SMILESNC(=O)c1cc(S(N)(=O)=O)cn1C1CC1
InChIInChI=1S/C8H11N3O3S/c9-8(12)7-3-6(15(10,13)14)4-11(7)5-1-2-5/h3-5H,1-2H2,(H2,9,12)(H2,10,13,14)
InChIKeyILSLQWWITCEFBP-UHFFFAOYSA-N
MW229.26 g/mol
LogP-0.43
Rot. Bonds3

About 1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide

1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide (PubChem CID 114612010) has the molecular formula C8H11N3O3S and a molecular weight of 229.26 g/mol. Its IUPAC name is 1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide.

Molecular Properties

Compound Name1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide
PubChem CID114612010
Molecular FormulaC8H11N3O3S
Molecular Weight229.26 g/mol
Exact Mass229.05
IUPAC Name1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide
SMILESNC(=O)c1cc(S(N)(=O)=O)cn1C1CC1
InChIInChI=1S/C8H11N3O3S/c9-8(12)7-3-6(15(10,13)14)4-11(7)5-1-2-5/h3-5H,1-2H2,(H2,9,12)(H2,10,13,14)
InChIKeyILSLQWWITCEFBP-UHFFFAOYSA-N
XLogP-0.43
TPSA108.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.26
LogP ≤ 5-0.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclobutyl-4-sulfamoylpyrrole-2-carboxylic acid
CID 114612783
1-cyclopropyl-N-methyl-4-sulfamoylpyrrole-2-carboxamide
CID 114611999
methyl 1-cyclopentyl-4-sulfamoylpyrrole-2-carboxylate
CID 114612610
methyl 1-cyclobutyl-4-sulfamoylpyrrole-2-carboxylate
CID 114612607
oxetan-3-yl 1-cyclopropyl-4-sulfamoylpyrrole-2-carboxylate
CID 102608651
N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide
CID 114612168
1-cyclopropyl-N-propan-2-yl-N-propyl-4-sulfamoylpyrrole-2-carboxamide
CID 114612118
1-cyclopropyl-N-methyl-N-(2-methylbutan-2-yl)-4-sulfamoylpyrrole-2-carboxamide
CID 114612371
1-cyclopropyl-N-(3-methylbutyl)-4-sulfamoylpyrrole-2-carboxamide
CID 114611971
1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide
CID 114611983
1-cyclopropyl-N-(2-methyloxolan-3-yl)-4-sulfamoylpyrrole-2-carboxamide
CID 114612454
N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide
CID 114611940

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide?
The IUPAC name of 1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide (CID 114612010) is 1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide.
What is the SMILES notation for 1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide?
The canonical SMILES for 1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide is NC(=O)c1cc(S(N)(=O)=O)cn1C1CC1.
What is the InChIKey of 1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide?
The InChIKey is ILSLQWWITCEFBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O3S/c9-8(12)7-3-6(15(10,13)14)4-11(7)5-1-2-5/h3-5H,1-2H2,(H2,9,12)(H2,10,13,14).
What are the key properties of 1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide?
1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide has a molecular weight of 229.26 g/mol, XLogP of -0.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide is sourced from PubChem (CID 114612010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).